BDBM50112275 9-Naphthalen-2-ylmethylene-7-aza-tricyclo[4.3.1.0*3,7*]decane-2-carboxylic acid methyl ester::CHEMBL58485

SMILES: COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1

InChI Key: InChIKey=XVOOTZXSASFQRD-GZTJUZNOSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50112275   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50112275 (9-Naphthalen-2-ylmethylene-7-aza-tricyclo[4.3.1.0*...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C22H23NO2/c1-25-22(24)21-19-12-18-8-9-20(21)23(18)13-17(19)11-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10-11,18-21H,8-9,12-13H2,1H3/b17-11+	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Inhibition of high affinity re-uptake of [3H]5-HT (serotonin) into nerve ending synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Norepinephrine Monoamine transporters (Rattus norvegicus)	BDBM50112275 (9-Naphthalen-2-ylmethylene-7-aza-tricyclo[4.3.1.0*...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C22H23NO2/c1-25-22(24)21-19-12-18-8-9-20(21)23(18)13-17(19)11-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10-11,18-21H,8-9,12-13H2,1H3/b17-11+	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	157	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]-NE (Norepinephrine transporter) into nerve ending synaptosomes prepared from brain regions				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50112275 (9-Naphthalen-2-ylmethylene-7-aza-tricyclo[4.3.1.0*...) Show SMILES COC(=O)C1C2CCC3CC1\C(CN23)=C\c1ccc2ccccc2c1 |TLB:6:5:11.12:8.9,THB:11:10:13:6.7,12:13:4.10.9:6.7,2:4:13:6.7,2:4:11.12:8.9| Show InChI InChI=1S/C22H23NO2/c1-25-22(24)21-19-12-18-8-9-20(21)23(18)13-17(19)11-14-6-7-15-4-2-3-5-16(15)10-14/h2-7,10-11,18-21H,8-9,12-13H2,1H3/b17-11+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	735	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Ability to inhibit high affinity reuptake of [3H]DA from dopamine transporter into nerve endings synaptosomes				J Med Chem 45: 1930-41 (2002) BindingDB Entry DOI: 10.7270/Q2M32WHG
					More data for this Ligand-Target Pair